4-[2-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-7-bromanyl-1,4-benzoxazin-3-one

Systemtic Name: 4-[2-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-7-bromanyl-1,4-benzoxazin-3-one Openeye Name: 4-[2-[3-(1,3-benzoxazol-2-yl)-1-piperidyl]-2-oxo-ethyl]-7-bromo-1,4-benzoxazin-3-one CAS Name: 4-[2-[3-(1,3-benzoxazol-2-yl)-1-piperidinyl]-2-oxoethyl]-7-bromo-1,4-benzoxazin-3-one IUPAC Name: 4-[2-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-oxoethyl]-7-bromo-1,4-benzoxazin-3-one Traditional Name: 4-[2-[3-(1,3-benzoxazol-2-yl)piperidino]-2-keto-ethyl]-7-bromo-1,4-benzoxazin-3-one Formula: C22H20BrN3O4 MolecularWeight: 470.3159

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CN2C(=O)COC3=C2C=CC(=C3)Br)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1CC(CN(C1)C(=O)CN2C(=O)COC3=C2C=CC(=C3)Br)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C22H20BrN3O4/c23-15-7-8-17-19(10-15)29-13-21(28)26(17)12-20(27)25-9-3-4-14(11-25)22-24-16-5-1-2-6-18(16)30-22/h1-2,5-8,10,14H,3-4,9,11-13H2